Geometry & MOs

Info

ID:	352458
PubChem CID:	127283546
Reduced:	NSO2C9H13 (2)
Stoich.:	ABC2D9E13 (2)
Weight, g/mol:	390.074171
ΔH_f, kcal/mol:	-148.66
Dipole, Da:	2.92
IP(EA), eV:	-8.73(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-oxo-1,4-thiazinan-4-yl)-2-(5-piperidin-1-ylsulfonylthiophen-2-yl)ethanone

Drug info:

PubChemData

Smile

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)N3CCS(=O)CC3

DOS

IR

Vibrations